CONFORMATION OF TRICYCLE [4.3.1.1(2,5)]UNDEC-3-EN-10-ONE

被引:3
作者
CAMPS, P [1 ]
VAZQUEZ, S [1 ]
JAIME, C [1 ]
VIRGILI, A [1 ]
机构
[1] UNIV AUTONOMA BARCELONA,DEPT QUIM,UNIDAD QUIM ORGAN,E-08193 BARCELONA,SPAIN
关键词
NMR; H-1; C-13 NMR MM3 PROGRAM; ALTONAS EQUATION; CONFORMATIONAL ANALYSIS; TRICYCLO[4.3.1.1(2,5)]UNDEC-3-EN-L0-ONE;
D O I
10.1002/mrc.1260320404
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
A high preference for the boat conformation of tricyclo[4.3.1.1(25)] undec-3-en-10-one was established on the basis of H-1 NMR spectroscopy with the aid of molecular mechanics calculations (MM3 program).
引用
收藏
页码:210 / 212
页数:3
相关论文
共 13 条
[1]  
Allinger N. L., 1980, QCPE, P395
[2]   CONFORMATIONAL-ANALYSIS .130. MM2 - HYDROCARBON FORCE-FIELD UTILIZING V1 AND V2 TORSIONAL TERMS [J].
ALLINGER, NL .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1977, 99 (25) :8127-8134
[3]   CONFORMATIONAL-ANALYSIS OF BICYCLO[3.3.1]NONANE-EXO-2,EXO-4-DICARBOXYLIC ACID-DERIVATIVES AND RELATED-COMPOUNDS [J].
CAMPS, P ;
CASTANE, J ;
FELIZ, M ;
JAIME, C ;
MINGUILLON, C .
CHEMISCHE BERICHTE, 1989, 122 (07) :1313-1322
[4]   BOAT-CHAIR CONFORMATIONAL PREFERENCE OF EXO,EXO-9-OXOBICYCLO[3.3.1]NONANE-2,4-DICARBOXYLIC ACID [J].
CAMPS, P ;
IGLESIAS, C .
TETRAHEDRON LETTERS, 1985, 26 (44) :5463-5464
[5]   THE CONFORMATION OF (1R,2S,4R,5S)-2,4-DIMETHOXYBICYCLO[3.3.1]NONAN-9-ONE AND SOME RELATED-COMPOUNDS [J].
CAMPS, P ;
JAIME, C .
ORGANIC MAGNETIC RESONANCE, 1980, 14 (03) :177-180
[6]   THE RELATIONSHIP BETWEEN PROTON-PROTON NMR COUPLING-CONSTANTS AND SUBSTITUENT ELECTRONEGATIVITIES .1. AN EMPIRICAL GENERALIZATION OF THE KARPLUS EQUATION [J].
HAASNOOT, CAG ;
DELEEUW, FAAM ;
ALTONA, C .
TETRAHEDRON, 1980, 36 (19) :2783-2792
[7]   APPLICATION OF EMPIRICAL POTENTIAL-ENERGY CALCULATIONS TO ORGANIC-CHEMISTRY .19. CONFORMATIONAL PREFERENCE IN 2,4-DIMETHOXYBICYCLO[3.3.1]NONAN-9-ONE AND RELATED MOLECULES - ANALYSIS OF VICINAL NMR COUPLING-CONSTANTS IN MULTIPLE ROTOR SYSTEM BY COMBINED MOLECULAR MECHANICS AND GENERALIZED KARPLUS EQUATION [J].
JAIME, C ;
OSAWA, E ;
TAKEUCHI, Y ;
CAMPS, P .
JOURNAL OF ORGANIC CHEMISTRY, 1983, 48 (24) :4514-4519
[8]  
OSAWA E, 1983, QCPE, V12, P461
[9]   SELECTIVE HETERONUCLEAR NOE ENHANCEMENTS IN BENZOHETEROCYCLES - EFFECT OF RING SIZE ON INDIRECT 3-SPIN EFFECTS [J].
REDONDO, J ;
SANCHEZFERRANDO, F ;
VALLS, M ;
VIRGILI, A .
MAGNETIC RESONANCE IN CHEMISTRY, 1988, 26 (06) :511-517